ethyl (E)-3-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)carbonylamino]but-2-enoate

Systemtic Name: ethyl (E)-3-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)carbonylamino]but-2-enoate Openeye Name: ethyl (E)-3-[(1-ethyl-3,5-dimethyl-pyrazole-4-carbonyl)amino]but-2-enoate CAS Name: (E)-3-[[(1-ethyl-3,5-dimethyl-4-pyrazolyl)-oxomethyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(1-ethyl-3,5-dimethylpyrazole-4-carbonyl)amino]but-2-enoate Traditional Name: (E)-3-[(1-ethyl-3,5-dimethyl-pyrazole-4-carbonyl)amino]but-2-enoic acid ethyl ester Formula: C14H21N3O3 MolecularWeight: 279.33484

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)C(=O)NC(=CC(=O)OCC)C)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)C(=O)N/C(=C/C(=O)OCC)/C)C

InChI

InChI=1S/C14H21N3O3/c1-6-17-11(5)13(10(4)16-17)14(19)15-9(3)8-12(18)20-7-2/h8H,6-7H2,1-5H3,(H,15,19)/b9-8+